General Information of the Compound
| Compound ID |
CP0383974
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| Compound Name |
US8969325, 155
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| Structure |
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| Formula |
C23H27FN4O3
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| Molecular Weight |
426.492
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| Canonical SMILES |
CCC1(CC)C[C@@H](NC(=O)Nc2cccc3N(C)C(=O)NCc23)c2cc(F)ccc2O1
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| InChI |
InChI=1S/C23H27FN4O3/c1-4-23(5-2)12-18(15-11-14(24)9-10-20(15)31-23)27-21(29)26-17-7-6-8-19-16(17)13-25-22(30)28(19)3/h6-11,18H,4-5,12-13H2,1-3H3,(H,25,30)(H2,26,27,29)/t18-/m1/s1
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| InChIKey |
YVBZMPAMHYXSFA-GOSISDBHSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound